SCHEMBL7388447

SCHEMBL7388447

CCOC(=O)CC(c1ccc(O[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)c1occ2cc(C#N)ccc12

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.49
ALK Q9UM73 1/20 0.41
USP30 Q70CQ3 1/20 0.37
CETP P11597 1/20 0.37
PGGT1B P53609 1/20 0.36
S1PR3 Q99500 1/20 0.36
F2 P00734 1/20 0.35
F10 P00742 1/20 0.35
PLG P00747 1/20 0.35
PRSS1 P07477 1/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35
TBK1 Q9UHD2 2/20 0.35
PIK3CD O00329 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7388442 0.86 GPR119 (0.51) GPR119ALKUSP30CETPF2
SCHEMBL7384317 0.84 GPR119 (0.49) GPR119ALKUSP30CETPF2
SCHEMBL7385390 0.82 GPR119 (0.48) GPR119ALKUSP30CETPS1PR3
SCHEMBL7387156 0.80 GPR119 (0.48) GPR119ALKUSP30CETPF2
SCHEMBL7389408 0.80 GPR119 (0.46) GPR119ALKCETPS1PR3PIK3CD
SCHEMBL7387574 0.79 GPR119 (0.49) GPR119ALKUSP30CETP
SCHEMBL7390112 0.78 THRB (0.41)
SCHEMBL7384792 0.78 GPR119 (0.49) GPR119ALKUSP30CETPF2
SCHEMBL7389231 0.78 GPR119 (0.54) GPR119ALKCETPF2F10
SCHEMBL7384952 0.78 GPR119 (0.47) GPR119ALKCETPS1PR3PIK3CD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5620991-A ANTICOAGULANTS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1997-04-15 US disclosed
US-5576343-A ANTICOAGULANTS; BLOOD-COAGULATION FACTOR X INHIBITORS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1996-11-19 US disclosed
EP-0540051-B1 Aromatic amidine derivatives and salts thereof DAIICHI SEIYAKU CO (JP) 1996-04-03 EP disclosed
EP-0540051-A1 Aromatic amidine derivatives and salts thereof DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1993-05-05 EP disclosed